Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c5i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A OG ASN 11.A OD1 no hydrogen 2.882 N/A TYR 12.A N SER 8.A O no hydrogen 3.110 N/A TYR 12.A OH ASP 388.A OD2 no hydrogen 2.828 N/A ILE 13.A N TRP 9.A O no hydrogen 2.944 N/A ASN 14.A N GLY 10.A O no hydrogen 2.987 N/A SER 15.A N ASN 11.A O no hydrogen 2.970 N/A SER 15.A OG ASN 11.A O no hydrogen 2.379 N/A ASN 16.A ND2 TYR 12.A O no hydrogen 2.753 N/A PHE 18.A N ILE 13.A O no hydrogen 2.958 N/A ALA 21.A N LYS 358.A O no hydrogen 3.073 N/A CYS 25.A N PRO 22.A O no hydrogen 3.067 N/A CYS 25.A SG HIS 351.A O no hydrogen 3.319 N/A CYS 25.A SG GLY 352.A O no hydrogen 3.478 N/A PHE 26.A N VAL 23.A O no hydrogen 3.083 N/A HIS 28.A NE2 LEU 405.A O no hydrogen 2.484 N/A ALA 29.A N PHE 26.A O no hydrogen 3.168 N/A GLY 32.A N ALA 29.A O no hydrogen 2.940 N/A ILE 38.A N TRP 35.A O no hydrogen 3.149 N/A SER 39.A OG ASP 37.A O no hydrogen 3.370 N/A ASN 41.A N ILE 63.A O no hydrogen 2.948 N/A ARG 43.A N LYS 133.A O no hydrogen 2.917 N/A ARG 43.A NH1 ARG 128.A O no hydrogen 3.360 N/A VAL 44.A N ALA 61.A O no hydrogen 2.864 N/A GLU 45.A N HIS 96.A O no hydrogen 2.938 N/A VAL 46.A N TRP 59.A O no hydrogen 3.120 N/A ASN 48.A N VAL 57.A O no hydrogen 2.595 N/A ASN 48.A ND2 VAL 109.A O no hydrogen 2.828 N/A THR 49.A N TYR 75.A OH no hydrogen 3.103 N/A ASP 50.A N ASN 48.A OD1 no hydrogen 2.900 N/A TRP 59.A N VAL 46.A O no hydrogen 2.910 N/A TRP 59.A NE1 GLU 76.A O no hydrogen 2.960 N/A ALA 61.A N VAL 44.A O no hydrogen 2.940 N/A GLY 62.A N ARG 74.A O no hydrogen 2.908 N/A ILE 63.A N VAL 42.A O no hydrogen 3.222 N/A VAL 64.A N LEU 72.A O no hydrogen 2.569 N/A LYS 65.A N LEU 72.A O no hydrogen 3.434 N/A LYS 65.A NZ ASN 14.A OD1 no hydrogen 3.052 N/A ALA 67.A N ASN 70.A O no hydrogen 2.704 N/A TYR 69.A N VAL 408.A O no hydrogen 2.673 N/A TYR 69.A OH PRO 30.A O no hydrogen 2.520 N/A ASN 70.A N ALA 67.A O no hydrogen 2.962 N/A ALA 71.A N CYS 88.A O no hydrogen 2.794 N/A LEU 72.A N LYS 65.A O no hydrogen 2.593 N/A LEU 73.A N PHE 86.A O no hydrogen 2.875 N/A ARG 74.A N GLY 62.A O no hydrogen 2.979 N/A ARG 74.A NE ASP 85.A OD1 no hydrogen 3.040 N/A ARG 74.A NE ASP 85.A OD2 no hydrogen 3.323 N/A ARG 74.A NH1 GLU 79.A O no hydrogen 2.728 N/A ARG 74.A NH2 ASP 85.A OD2 no hydrogen 2.813 N/A TYR 75.A OH PRO 47.A O no hydrogen 2.943 N/A GLU 76.A N ILE 60.A O no hydrogen 2.765 N/A PHE 78.A N TYR 75.A O no hydrogen 3.296 N/A ASP 81.A N PHE 78.A O no hydrogen 2.845 N/A GLY 83.A N ASP 81.A OD1 no hydrogen 2.926 N/A ASP 85.A N SER 82.A O no hydrogen 3.380 N/A PHE 86.A N LEU 73.A O no hydrogen 3.118 N/A CYS 88.A N ALA 71.A O no hydrogen 3.130 N/A CYS 88.A SG ALA 71.A O no hydrogen 3.610 N/A ILE 90.A N TYR 69.A O no hydrogen 2.940 N/A CYS 91.A N ASN 89.A OD1 no hydrogen 2.987 N/A GLY 92.A N ASN 89.A O no hydrogen 2.672 N/A ILE 95.A N GLY 92.A O no hydrogen 3.424 N/A HIS 96.A N GLU 45.A O no hydrogen 3.043 N/A TRP 100.A N PRO 97.A O no hydrogen 3.372 N/A CYS 101.A N GLU 45.A OE1 no hydrogen 2.890 N/A CYS 101.A SG LYS 106.A O no hydrogen 3.348 N/A ALA 103.A N GLY 99.A O no hydrogen 3.105 N/A SER 104.A OG TRP 100.A O no hydrogen 2.940 N/A LYS 106.A N CYS 101.A O no hydrogen 2.544 N/A VAL 109.A N PHE 58.A O no hydrogen 2.988 N/A ARG 112.A N ASP 50.A O no hydrogen 2.883 N/A THR 113.A N ASP 50.A OD2 no hydrogen 2.749 N/A THR 113.A OG1 ASP 50.A OD2 no hydrogen 2.683 N/A ILE 114.A N PRO 111.A O no hydrogen 3.295 N/A LYS 117.A N ILE 114.A O no hydrogen 3.122 N/A LYS 117.A NZ GLY 77.A O no hydrogen 2.999 N/A PHE 124.A N ASN 120.A O no hydrogen 3.113 N/A LEU 125.A N TRP 121.A O no hydrogen 2.895 N/A VAL 126.A N LYS 122.A O no hydrogen 3.094 N/A LYS 127.A N ALA 123.A O no hydrogen 3.050 N/A ARG 128.A N PHE 124.A O no hydrogen 3.036 N/A ARG 128.A NH1 GLU 76.A OE2 no hydrogen 3.410 N/A ARG 128.A NH1 GLU 79.A OE2 no hydrogen 2.550 N/A ARG 128.A NH2 TYR 118.A OH no hydrogen 3.252 N/A LEU 129.A N LEU 125.A O no hydrogen 2.823 N/A THR 130.A N VAL 126.A O no hydrogen 3.305 N/A ALA 132.A N LEU 129.A O no hydrogen 2.938 N/A THR 134.A OG1 ARG 43.A O no hydrogen 2.897 N/A LEU 135.A N THR 134.A OG1 no hydrogen 2.504 N/A GLN 141.A NE2 GLU 145.A OE2 no hydrogen 3.219 N/A LYS 142.A N ASP 138.A O no hydrogen 3.225 N/A VAL 143.A N PHE 139.A O no hydrogen 2.971 N/A SER 144.A N SER 140.A O no hydrogen 3.061 N/A GLU 145.A N GLN 141.A O no hydrogen 2.902 N/A SER 146.A N LYS 142.A O no hydrogen 2.993 N/A SER 146.A OG VAL 143.A O no hydrogen 2.491 N/A MET 147.A N SER 144.A O no hydrogen 3.022 N/A GLN 148.A N GLU 145.A O no hydrogen 3.011 N/A LYS 152.A NZ TYR 149.A O no hydrogen 3.235 N/A CYS 154.A N VAL 173.A O no hydrogen 2.699 N/A ARG 156.A N PHE 225.A O no hydrogen 2.949 N/A ARG 156.A NE GLU 186.A OE2 no hydrogen 2.590 N/A ARG 156.A NH1 ASP 226.A OD1 no hydrogen 2.578 N/A ARG 156.A NH2 GLU 186.A OE1 no hydrogen 3.033 N/A ARG 156.A NH2 GLU 186.A OE2 no hydrogen 3.109 N/A VAL 157.A N ALA 171.A O no hydrogen 2.960 N/A GLU 158.A N HIS 205.A O no hydrogen 2.799 N/A VAL 159.A N ARG 169.A O no hydrogen 3.074 N/A ASP 161.A N ARG 167.A O no hydrogen 2.892 N/A LYS 162.A N TYR 185.A OH no hydrogen 3.120 N/A LYS 162.A NZ ASP 193.A OD1 no hydrogen 3.222 N/A LYS 162.A NZ ASP 194.A O no hydrogen 3.120 N/A ARG 163.A N ASP 161.A OD1 no hydrogen 3.390 N/A ARG 163.A NH1 ASP 193.A OD2 no hydrogen 3.555 N/A ARG 163.A NH2 ASP 193.A OD1 no hydrogen 2.989 N/A HIS 164.A N ASP 161.A O no hydrogen 2.989 N/A CYS 166.A N SER 289.A O no hydrogen 3.309 N/A CYS 166.A SG GLY 288.A O no hydrogen 3.092 N/A ARG 167.A N HIS 164.A O no hydrogen 3.083 N/A THR 168.A N ARG 216.A O no hydrogen 2.945 N/A THR 168.A OG1 SER 210.A OG no hydrogen 2.366 N/A ARG 169.A N VAL 159.A O no hydrogen 2.896 N/A ARG 169.A NH1 ASP 161.A OD1 no hydrogen 3.101 N/A ARG 169.A NH1 ASP 161.A OD2 no hydrogen 3.278 N/A ALA 171.A N VAL 157.A O no hydrogen 2.926 N/A VAL 172.A N VAL 184.A O no hydrogen 2.700 N/A VAL 173.A N MET 155.A O no hydrogen 2.850 N/A GLU 174.A N ARG 182.A O no hydrogen 3.088 N/A SER 175.A OG GLU 174.A OE2 no hydrogen 3.237 N/A ILE 177.A N ARG 180.A O no hydrogen 2.840 N/A ARG 180.A N ILE 177.A O no hydrogen 2.956 N/A ARG 180.A NH1 ASP 404.A OD1 no hydrogen 3.294 N/A ARG 180.A NH1 TYR 406.A OH no hydrogen 2.548 N/A LEU 181.A N CYS 197.A O no hydrogen 2.634 N/A ARG 182.A N SER 175.A O no hydrogen 2.916 N/A ARG 182.A NE ASP 194.A OD2 no hydrogen 3.265 N/A ARG 182.A NH1 GLU 174.A OE2 no hydrogen 2.932 N/A ARG 182.A NH2 ASP 194.A OD2 no hydrogen 3.233 N/A LEU 183.A N PHE 195.A O no hydrogen 3.168 N/A VAL 184.A N VAL 172.A O no hydrogen 2.924 N/A TYR 185.A OH VAL 160.A O no hydrogen 3.144 N/A GLU 186.A N VAL 170.A O no hydrogen 2.896 N/A ASP 193.A N ASP 190.A O no hydrogen 3.489 N/A PHE 195.A N LEU 183.A O no hydrogen 2.698 N/A CYS 197.A N LEU 181.A O no hydrogen 3.142 N/A CYS 197.A SG HIS 198.A O no hydrogen 3.534 N/A MET 199.A N GLY 179.A O no hydrogen 2.873 N/A HIS 200.A N HIS 198.A ND1 no hydrogen 3.040 N/A SER 201.A N HIS 198.A O no hydrogen 3.207 N/A LEU 203.A N SER 201.A OG no hydrogen 3.097 N/A HIS 205.A N GLU 158.A O no hydrogen 2.822 N/A GLY 208.A N GLU 158.A OE2 no hydrogen 2.658 N/A TRP 209.A N HIS 206.A O no hydrogen 3.123 N/A SER 210.A N GLU 158.A OE1 no hydrogen 2.960 N/A SER 210.A OG GLU 158.A OE1 no hydrogen 2.644 N/A SER 210.A OG THR 168.A OG1 no hydrogen 2.366 N/A SER 212.A N GLY 208.A O no hydrogen 3.042 N/A ILE 213.A N TRP 209.A O no hydrogen 2.884 N/A GLY 214.A N SER 210.A O no hydrogen 2.920 N/A HIS 215.A ND1 ARG 216.A O no hydrogen 2.856 N/A ARG 216.A NH1 ASP 287.A O no hydrogen 3.311 N/A LYS 218.A N THR 168.A O no hydrogen 2.793 N/A SER 220.A OG GLU 187.A OE2 no hydrogen 2.927 N/A PHE 225.A N CYS 154.A O no hydrogen 3.315 N/A THR 227.A N ARG 156.A O no hydrogen 3.231 N/A THR 227.A OG1 ARG 156.A O no hydrogen 2.607 N/A LEU 231.A N PRO 228.A O no hydrogen 2.875 N/A PHE 232.A N PRO 229.A O no hydrogen 3.307 N/A GLN 240.A NE2 LEU 271.A O no hydrogen 3.259 N/A SER 241.A N ASP 239.A OD1 no hydrogen 3.250 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 2.490 N/A GLY 248.A N ILE 267.A O no hydrogen 2.818 N/A MET 249.A N LYS 246.A O no hydrogen 3.162 N/A LYS 250.A N ILE 337.A O no hydrogen 2.830 N/A LYS 250.A NZ THR 266.A OG1 no hydrogen 2.955 N/A LYS 250.A NZ ASP 281.A OD2 no hydrogen 2.599 N/A LEU 251.A N ALA 265.A O no hydrogen 2.956 N/A GLU 252.A N PHE 302.A O no hydrogen 2.839 N/A ALA 253.A N CYS 263.A O no hydrogen 2.891 N/A ILE 254.A N SER 300.A O no hydrogen 2.984 N/A ASP 255.A N THR 261.A O no hydrogen 3.175 N/A LEU 257.A N ASP 255.A OD1 no hydrogen 3.025 N/A ASN 258.A N ASP 255.A O no hydrogen 3.026 N/A SER 260.A N ASN 258.A OD1 no hydrogen 3.252 N/A SER 260.A OG ASP 395.A O no hydrogen 2.999 N/A THR 261.A N ASN 258.A O no hydrogen 3.194 N/A THR 261.A OG1 ASN 258.A O no hydrogen 3.161 N/A CYS 263.A N ALA 253.A O no hydrogen 2.568 N/A CYS 263.A SG THR 261.A OG1 no hydrogen 3.584 N/A VAL 264.A N THR 315.A O no hydrogen 3.438 N/A ALA 265.A N LEU 251.A O no hydrogen 2.735 N/A THR 266.A N GLY 279.A O no hydrogen 2.894 N/A THR 266.A OG1 ASP 281.A OD1 no hydrogen 2.886 N/A ILE 267.A N MET 249.A O no hydrogen 2.955 N/A ARG 268.A N MET 277.A O no hydrogen 2.747 N/A LYS 269.A N MET 277.A O no hydrogen 3.235 N/A LEU 271.A N PHE 275.A O no hydrogen 2.901 N/A ALA 272.A N ILE 213.A O no hydrogen 3.275 N/A GLY 274.A N GLN 240.A OE1 no hydrogen 2.958 N/A PHE 275.A N ALA 272.A O no hydrogen 3.362 N/A LEU 276.A N TYR 294.A O no hydrogen 2.976 N/A MET 277.A N LYS 269.A O no hydrogen 2.847 N/A ILE 278.A N PHE 292.A O no hydrogen 2.728 N/A GLY 279.A N THR 266.A O no hydrogen 3.032 N/A ASP 281.A N VAL 264.A O no hydrogen 3.278 N/A SER 283.A N ILE 280.A O no hydrogen 3.026 N/A ALA 285.A N ASP 290.A OD2 no hydrogen 2.832 N/A GLY 288.A N ALA 285.A O no hydrogen 3.001 N/A SER 289.A N ASP 287.A OD1 no hydrogen 3.344 N/A SER 289.A OG ASP 287.A OD1 no hydrogen 3.036 N/A PHE 292.A N ILE 278.A O no hydrogen 2.915 N/A CYS 293.A SG LEU 276.A O no hydrogen 3.769 N/A TYR 294.A N LEU 276.A O no hydrogen 3.041 N/A TYR 294.A OH ILE 254.A O no hydrogen 2.691 N/A HIS 295.A ND1 THR 297.A OG1 no hydrogen 2.628 N/A HIS 295.A NE2 ASP 273.A O no hydrogen 2.958 N/A ALA 296.A N GLY 274.A O no hydrogen 2.920 N/A THR 297.A N HIS 295.A ND1 no hydrogen 3.147 N/A THR 297.A OG1 HIS 295.A ND1 no hydrogen 2.628 N/A SER 298.A N HIS 295.A O no hydrogen 3.074 N/A SER 300.A N SER 298.A OG no hydrogen 3.233 N/A PHE 302.A N GLU 252.A O no hydrogen 2.546 N/A GLY 305.A N GLU 252.A OE2 no hydrogen 3.141 N/A PHE 306.A N PRO 303.A O no hydrogen 3.249 N/A CYS 307.A N GLU 252.A OE1 no hydrogen 3.088 N/A CYS 307.A SG GLU 252.A OE1 no hydrogen 3.193 N/A ILE 309.A N GLY 305.A O no hydrogen 3.206 N/A ASN 310.A N PHE 306.A O no hydrogen 3.188 N/A ASN 310.A ND2 PHE 306.A O no hydrogen 3.268 N/A MET 311.A N GLU 308.A O no hydrogen 3.169 N/A ILE 312.A N CYS 307.A O no hydrogen 2.467 N/A THR 315.A N ILE 262.A O no hydrogen 2.964 N/A TYR 320.A N PRO 317.A O no hydrogen 3.092 N/A TYR 320.A OH GLU 333.A OE2 no hydrogen 3.156 N/A LYS 322.A NZ GLU 333.A OE2 no hydrogen 3.394 N/A TRP 327.A NE1 GLU 252.A OE2 no hydrogen 2.921 N/A TYR 330.A N LYS 326.A O no hydrogen 3.142 N/A TYR 330.A OH ASP 281.A OD2 no hydrogen 2.607 N/A LEU 331.A N TRP 327.A O no hydrogen 2.850 N/A ARG 332.A N PHE 328.A O no hydrogen 3.282 N/A ARG 332.A NH2 ASP 329.A OD1 no hydrogen 2.510 N/A GLU 333.A N ASP 329.A O no hydrogen 2.980 N/A THR 334.A N TYR 330.A O no hydrogen 3.011 N/A THR 334.A OG1 TYR 330.A O no hydrogen 2.650 N/A THR 334.A OG1 SER 336.A OG no hydrogen 2.832 N/A GLY 335.A N ARG 332.A O no hydrogen 3.300 N/A SER 336.A N LEU 331.A O no hydrogen 3.126 N/A SER 336.A OG THR 334.A OG1 no hydrogen 2.832 N/A ALA 339.A N LYS 250.A O no hydrogen 2.966 N/A LEU 343.A N PRO 340.A O no hydrogen 3.127 N/A PHE 344.A N VAL 341.A O no hydrogen 2.834 N/A LYS 346.A NZ PHE 344.A O no hydrogen 2.938 N/A HIS 351.A NE2 HIS 380.A O no hydrogen 2.969 N/A PHE 353.A N HIS 351.A ND1 no hydrogen 3.039 N/A GLY 356.A N VAL 375.A O no hydrogen 2.671 N/A MET 357.A N ARG 354.A O no hydrogen 3.113 N/A LYS 358.A N ILE 19.A O no hydrogen 2.735 N/A LYS 358.A NZ THR 374.A OG1 no hydrogen 2.689 N/A LYS 358.A NZ ASP 388.A OD2 no hydrogen 2.575 N/A LEU 359.A N ALA 373.A O no hydrogen 3.034 N/A GLU 360.A N TYR 406.A O no hydrogen 2.742 N/A ALA 361.A N CYS 371.A O no hydrogen 2.956 N/A VAL 362.A N ASP 404.A O no hydrogen 3.081 N/A ASP 363.A N LEU 369.A O no hydrogen 2.941 N/A LEU 364.A N GLN 396.A OE1 no hydrogen 3.094 N/A MET 365.A N ASP 363.A OD1 no hydrogen 3.015 N/A GLU 366.A N ASP 363.A O no hydrogen 3.001 N/A LEU 369.A N GLU 366.A O no hydrogen 2.829 N/A CYS 371.A N ALA 361.A O no hydrogen 2.868 N/A VAL 372.A N GLN 419.A O no hydrogen 3.042 N/A ALA 373.A N LEU 359.A O no hydrogen 2.934 N/A THR 374.A N HIS 386.A O no hydrogen 2.799 N/A THR 374.A OG1 ASP 388.A OD1 no hydrogen 2.729 N/A VAL 375.A N MET 357.A O no hydrogen 3.071 N/A THR 376.A N ARG 384.A O no hydrogen 2.911 N/A THR 376.A OG1 ARG 384.A O no hydrogen 3.062 N/A ARG 377.A NH1 MET 311.A O no hydrogen 3.464 N/A ARG 377.A NH2 ASN 310.A O no hydrogen 3.406 N/A ARG 377.A NH2 MET 311.A O no hydrogen 3.284 N/A ILE 379.A N LEU 382.A O no hydrogen 2.629 N/A ARG 381.A NE ASP 399.A OD1 no hydrogen 2.750 N/A ARG 381.A NH1 ASP 347.A O no hydrogen 2.869 N/A ARG 381.A NH2 ASP 399.A OD1 no hydrogen 3.426 N/A ARG 381.A NH2 ASP 399.A OD2 no hydrogen 2.938 N/A ARG 381.A NH2 GLU 401.A OE1 no hydrogen 3.267 N/A LEU 382.A N ILE 379.A O no hydrogen 2.724 N/A LEU 383.A N VAL 398.A O no hydrogen 2.719 N/A ARG 384.A N ARG 377.A O no hydrogen 2.963 N/A ARG 384.A NH1 SER 260.A O no hydrogen 3.036 N/A ILE 385.A N GLN 396.A O no hydrogen 2.887 N/A HIS 386.A N THR 374.A O no hydrogen 2.775 N/A HIS 386.A ND1 ASP 395.A OD1 no hydrogen 2.776 N/A ASP 388.A N VAL 372.A O no hydrogen 3.299 N/A TRP 390.A N PHE 387.A O no hydrogen 3.103 N/A GLU 391.A N GLU 391.A OE1 no hydrogen 3.215 N/A GLU 393.A N GLU 393.A OE1 no hydrogen 2.855 N/A TYR 394.A N GLU 391.A O no hydrogen 3.177 N/A ASP 395.A N GLU 392.A O no hydrogen 3.294 N/A GLN 396.A N ILE 385.A O no hydrogen 3.015 N/A GLN 396.A NE2 ASP 363.A OD1 no hydrogen 2.892 N/A TRP 397.A N LEU 259.A O no hydrogen 2.787 N/A VAL 398.A N LEU 383.A O no hydrogen 2.830 N/A CYS 400.A N ARG 381.A O no hydrogen 2.957 N/A CYS 400.A SG ARG 381.A O no hydrogen 3.622 N/A GLU 401.A N ASP 399.A OD2 no hydrogen 3.325 N/A SER 402.A N ASP 399.A O no hydrogen 3.208 N/A ASP 404.A N SER 402.A OG no hydrogen 2.965 N/A TYR 406.A N GLU 360.A O no hydrogen 2.672 N/A GLY 409.A N GLU 360.A OE2 no hydrogen 3.009 N/A TRP 410.A N PRO 407.A O no hydrogen 3.269 N/A CYS 411.A N GLU 360.A OE1 no hydrogen 2.816 N/A CYS 411.A SG GLU 360.A OE1 no hydrogen 3.186 N/A CYS 411.A SG GLN 417.A O no hydrogen 4.024 N/A LEU 413.A N GLY 409.A O no hydrogen 2.913 N/A THR 414.A N TRP 410.A O no hydrogen 2.887 N/A THR 414.A OG1 TRP 410.A O no hydrogen 2.679 N/A THR 414.A OG1 CYS 411.A O no hydrogen 3.501 N/A GLY 415.A N CYS 411.A O no hydrogen 2.690 N/A TYR 416.A N CYS 411.A O no hydrogen 2.987 N/A TYR 416.A OH ARG 368.A O no hydrogen 2.634 N/A GLN 417.A NE2 LEU 418.A O no hydrogen 2.993 N/A GLN 419.A N ILE 370.A O no hydrogen 2.800 N/A ALA 422.A N ASP 388.A O no hydrogen 3.313 N/A